Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-
TL;DR: Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl- (CAS 57338-58-6) is a chemical compound with molecular formula C12H10BrN3O3 and molecular weight 322.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-bromo-2-methyl-4-nitroimidazol-1-yl)-1-phenylethanone
Also Known As: 1-phenacyl-2-methyl-4-nitro-5-bromoimidazole, 5-bromo-2-methyl-4-nitro-1-phenacylimidazole, J1.077.101C, 2-(5-bromo-2-methyl-4-nitroimidazol-1-yl)-1-phenylethanone, Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-
| Molecular Formula | C12H10BrN3O3 |
|---|---|
| Molecular Weight | 322.99 g/mol |
| LogP | 2.74512 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.99054 |
| Heavy Atoms | 19 |
| Complexity | 637.1692 |
Chemical Identifiers
| CAS Number | 57338-58-6 |
|---|---|
| SMILES | CC1=NC(=C(N1CC(=O)C2=CC=CC=C2)Br)[N+](=O)[O-] |
Product Overview
Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl- (CAS 57338-58-6), with molecular formula C12H10BrN3O3 and molecular weight 322.99 g/mol. IUPAC: 2-(5-bromo-2-methyl-4-nitroimidazol-1-yl)-1-phenylethanone.
Chemical Property Profile of Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-
Property Insights of Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-
The XLogP value of 2.74512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-. Following Lipinski's Rule of Five, Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-?
The CAS number of Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl- is 57338-58-6.
What is the molecular formula of Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-?
The molecular formula of Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl- is C12H10BrN3O3.
What is the molecular weight of Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-?
The molecular weight of Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl- is 322.99 g/mol.
Where can I buy Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-?
You can request a quote for Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 2-(5-bromo-2-methyl-4-nitro-1H-imidazol-1-yl)-1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.